1-[(3S,6S)-6-(4-fluorophenyl)-2-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]-3-prop-1-en-2-yl-benzimidazol-2-one

Systemtic Name: 1-[(3S,6S)-6-(4-fluorophenyl)-2-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]-3-prop-1-en-2-yl-benzimidazol-2-one Openeye Name: 1-[(3S,6S)-1-benzyl-6-(4-fluorophenyl)-2-oxo-3-piperidyl]-3-isopropenyl-benzimidazol-2-one CAS Name: 1-[(3S,6S)-6-(4-fluorophenyl)-2-oxo-1-(phenylmethyl)-3-piperidinyl]-3-(1-methylethenyl)-2-benzimidazolone IUPAC Name: 1-[(3S,6S)-1-benzyl-6-(4-fluorophenyl)-2-oxopiperidin-3-yl]-3-prop-1-en-2-ylbenzimidazol-2-one Traditional Name: 1-[(3S,6S)-1-benzyl-6-(4-fluorophenyl)-2-keto-3-piperidyl]-3-isopropenyl-benzimidazol-2-one Formula: C28H26FN3O2 MolecularWeight: 455.523343

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)N1C2=CC=CC=C2N(C1=O)C3CCC(N(C3=O)CC4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CC(=C)N1C2=CC=CC=C2N(C1=O)[C@H]3CC[C@H](N(C3=O)CC4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H26FN3O2/c1-19(2)31-24-10-6-7-11-25(24)32(28(31)34)26-17-16-23(21-12-14-22(29)15-13-21)30(27(26)33)18-20-8-4-3-5-9-20/h3-15,23,26H,1,16-18H2,2H3/t23-,26-/m0/s1